1.0 2010-04-08 22:15:41 UTC 2019-11-26 03:20:21 UTC FDB021420 2,3-Dihydro-2,3-dihydroxy-4-(4-methoxyphenyl)-1H-phenalen-1-one Constituent of Musa acuminata (dwarf banana) infected with Colletotrichum musae. 2,3-Dihydro-2,3-dihydroxy-4-(4-methoxyphenyl)-1H-phenalen-1-one is found in fruits. 2,3-Dihydro-2,3-dihydroxy-4-(4-methoxyphenyl)-1H-phenalen-1-one C20H16O4 320.3386 320.104859 2,3-dihydroxy-4-(4-methoxyphenyl)-2,3-dihydro-1H-phenalen-1-one 2,3-dihydroxy-4-(4-methoxyphenyl)-2,3-dihydrophenalen-1-one 159853-37-9 COC1=CC=C(C=C1)C1=C2C(O)C(O)C(=O)C3=CC=CC(C=C1)=C23 InChI=1S/C20H16O4/c1-24-13-8-5-11(6-9-13)14-10-7-12-3-2-4-15-16(12)17(14)19(22)20(23)18(15)21/h2-10,19-20,22-23H,1H3 GMMBTTCHJJMJKQ-UHFFFAOYSA-N belongs to the class of organic compounds known as phenylnaphthalenes. Phenylnaphthalenes are compounds containing a phenylnaphthalene skeleton, which consists of a naphthalene bound to a phenyl group. Phenylnaphthalenes Organic compounds Benzenoids Naphthalenes Phenylnaphthalenes Aromatic homopolycyclic compounds 1,2-diols Alkyl aryl ethers Anisoles Aryl alkyl ketones Hydrocarbon derivatives Methoxybenzenes Organic oxides Phenalanes Phenoxy compounds Secondary alcohols 1,2-diol Alcohol Alkyl aryl ether Anisole Aromatic homopolycyclic compound Aryl alkyl ketone Aryl ketone Ether Hydrocarbon derivative Ketone Methoxybenzene Monocyclic benzene moiety Organic oxide Organic oxygen compound Organooxygen compound Phenalane Phenol ether Phenoxy compound Phenylnaphthalene Secondary alcohol logp 2.81 ALOGPS logs -4.05 ALOGPS solubility 2.83e-02 g/l ALOGPS melting_point Mp 175-177° logp 2.53 ChemAxon pka_strongest_acidic 12.16 ChemAxon pka_strongest_basic -3.5 ChemAxon iupac 2,3-dihydroxy-4-(4-methoxyphenyl)-2,3-dihydro-1H-phenalen-1-one ChemAxon average_mass 320.3386 ChemAxon mono_mass 320.104859 ChemAxon smiles COC1=CC=C(C=C1)C1=C2C(O)C(O)C(=O)C3=CC=CC(C=C1)=C23 ChemAxon formula C20H16O4 ChemAxon inchi InChI=1S/C20H16O4/c1-24-13-8-5-11(6-9-13)14-10-7-12-3-2-4-15-16(12)17(14)19(22)20(23)18(15)21/h2-10,19-20,22-23H,1H3 ChemAxon inchikey GMMBTTCHJJMJKQ-UHFFFAOYSA-N ChemAxon polar_surface_area 66.76 ChemAxon refractivity 90.48 ChemAxon polarizability 33.53 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 4 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 13679 Specdb::CMs 47335 Specdb::CMs 146594 Specdb::MsMs 296149 Specdb::MsMs 296150 Specdb::MsMs 296151 Specdb::MsMs 337372 Specdb::MsMs 337373 Specdb::MsMs 337374 Specdb::MsMs 2365291 Specdb::MsMs 2365292 Specdb::MsMs 2365293 Specdb::MsMs 2596480 Specdb::MsMs 2596481 Specdb::MsMs 2596482 HMDB41463 #<Reference:0x000055ce322077f8> Fruits Unknown generic